IF 31
TL;DR: IF 31 (CAS 63170-60-5) is a chemical compound with molecular formula C27H24ClNO4 and molecular weight 461.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenylethyl 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetate
Also Known As: IF 31, alpha-Methylbenzyl 1-(p-chlorobenzoyl)-5-methoxy-2-methyl-1H-indole-3-acetate, 1H-Indole-3-acetic acid, 1-(p-chlorobenzoyl)-5-methoxy-2-methyl-, alpha-methylbenzyl ester, 2-AMINO-3-METHYL-9H-PYRIDO[2,3-B]INDOLE ACETATE, 1-phenylethyl 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetate
| Molecular Formula | C27H24ClNO4 |
|---|---|
| Molecular Weight | 461.14 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 461.13937 |
| Heavy Atoms | 33 |
| Complexity | 673.0 |
Chemical Identifiers
| CAS Number | 63170-60-5 |
|---|---|
| SMILES | CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)OC(C)C4=CC=CC=C4 |
| InChIKey | KYNSOZVURQLGOK-UHFFFAOYSA-N |
Product Overview
IF 31 (CAS 63170-60-5), with molecular formula C27H24ClNO4 and molecular weight 461.14 g/mol. IUPAC: 1-phenylethyl 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetate.
Chemical Property Profile of IF 31
Property Insights of IF 31
The XLogP value of 6.5 indicates that IF 31 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.5 Ų, IF 31 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, IF 31 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of IF 31?
The CAS number of IF 31 is 63170-60-5.
What is the molecular formula of IF 31?
The molecular formula of IF 31 is C27H24ClNO4.
What is the molecular weight of IF 31?
The molecular weight of IF 31 is 461.14 g/mol.
Where can I buy IF 31?
You can request a quote for IF 31 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IF 31?
Yes, KEHONG BIO provides custom synthesis services for IF 31 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.